(2S)-1-[(3,4-dimethoxyphenyl)methoxy]-3-morpholin-4-ium-4-yl-propan-2-ol

Systemtic Name: (2S)-1-[(3,4-dimethoxyphenyl)methoxy]-3-morpholin-4-ium-4-yl-propan-2-ol Openeye Name: (2S)-1-[(3,4-dimethoxyphenyl)methoxy]-3-morpholin-4-ium-4-yl-propan-2-ol CAS Name: (2S)-1-[(3,4-dimethoxyphenyl)methoxy]-3-(4-morpholin-4-iumyl)-2-propanol IUPAC Name: (2S)-1-[(3,4-dimethoxyphenyl)methoxy]-3-morpholin-4-ium-4-ylpropan-2-ol Traditional Name: (2S)-1-morpholin-4-ium-4-yl-3-veratryloxy-propan-2-ol Formula: C16H26NO5+ MolecularWeight: 312.38134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COCC(C[NH+]2CCOCC2)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)COC[C@H](C[NH+]2CCOCC2)O)OC

InChI

InChI=1S/C16H25NO5/c1-19-15-4-3-13(9-16(15)20-2)11-22-12-14(18)10-17-5-7-21-8-6-17/h3-4,9,14,18H,5-8,10-12H2,1-2H3/p+1/t14-/m0/s1